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	hartrees
Energy at 0K	-224.410299
Energy at 298.15K	-224.411925
HF Energy	-223.682396
Nuclear repulsion energy	124.016250

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3108	2953	0.19
2	A₁	2205	2096	1.77
3	A₁	1497	1422	15.00
4	A₁	910	865	5.40
5	A₁	579	550	0.12
6	A₁	144	137	9.51
7	A₂	1278	1215	0.00
8	A₂	355	337	0.00
9	B₁	3159	3002	2.57
10	B₁	955	908	0.27
11	B₁	328	312	0.03
12	B₂	2211	2101	6.39
13	B₂	1367	1299	1.23
14	B₂	997	948	6.14
15	B₂	362	344	0.31

Atom	x (Å)	y (Å)	z (Å)
C1	0.000	0.000	0.852
C2	0.000	1.216	0.030
C3	0.000	-1.216	0.030
H4	0.883	0.000	1.495
H5	-0.883	0.000	1.495
N6	0.000	2.194	-0.604
N7	0.000	-2.194	-0.604

	C1	C2	C3	H4	H5	N6	N7
C1		1.4673	1.4673	1.0930	1.0930	2.6332	2.6332
C2	1.4673		2.4317	2.0988	2.0988	1.1661	3.4685
C3	1.4673	2.4317		2.0988	2.0988	3.4685	1.1661
H4	1.0930	2.0988	2.0988		1.7666	3.1628	3.1628
H5	1.0930	2.0988	2.0988	1.7666		3.1628	3.1628
N6	2.6332	1.1661	3.4685	3.1628	3.1628		4.3882
N7	2.6332	3.4685	1.1661	3.1628	3.1628	4.3882

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
C1	C2	N6	178.932	C1	C3	N7	178.932
C2	C1	C3	111.918	C2	C1	H4	109.251
C2	C1	H5	109.251	C3	C1	H4	109.251
C3	C1	H5	109.251	H4	C1	H5	107.831

All results from a given calculation for C₃H₂N₂ (Malononitrile)

using model chemistry: MP2/6-311G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for C3H2N2 (Malononitrile)

using model chemistry: MP2/6-311G*

States and conformations

All results from a given calculation for C₃H₂N₂ (Malononitrile)